ethyl 1-[[4-[(4-chlorophenyl)carbamoyl]cyclohexyl]methyl]-2,5-dimethyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[[4-[(4-chlorophenyl)carbamoyl]cyclohexyl]methyl]-2,5-dimethyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[[4-[(4-chlorophenyl)carbamoyl]cyclohexyl]methyl]-2,5-dimethyl-pyrrole-3-carboxylate CAS Name: 1-[[4-[(4-chloroanilino)-oxomethyl]cyclohexyl]methyl]-2,5-dimethyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-[(4-chlorophenyl)carbamoyl]cyclohexyl]methyl]-2,5-dimethylpyrrole-3-carboxylate Traditional Name: 1-[[4-[(4-chlorophenyl)carbamoyl]cyclohexyl]methyl]-2,5-dimethyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H29ClN2O3 MolecularWeight: 416.94096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C)CC2CCC(CC2)C(=O)NC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C)CC2CCC(CC2)C(=O)NC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C23H29ClN2O3/c1-4-29-23(28)21-13-15(2)26(16(21)3)14-17-5-7-18(8-6-17)22(27)25-20-11-9-19(24)10-12-20/h9-13,17-18H,4-8,14H2,1-3H3,(H,25,27)